Basic information
- CAS
887611-92-9- Standard SMILES
C=CCC1=C(OC(C)=O)c2cc(F)ccc2Cc2ccccc21- InChIKey
GAGGEGANPLEWSU-UHFFFAOYSA-N- Molecular formula
- C20H17FO2
- Average molar mass
- 308.3 g/mol
- Monoisotopic mass
- 308.12125794
Names & identifiers
- Preferred name
- 5H-Dibenzo[a,d]cyclohepten-10-ol, 8-fluoro-11-(2-propen-1-yl)-, 10-acetate
- IUPAC
- (6-fluoro-10-prop-2-enyl-9-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,9,11,13-heptaenyl) acetate
Names & synonyms
887611-92-95H-Dibenzo[a,d]cyclohepten-10-ol, 8-fluoro-11-(2-propen-1-yl)-, 10-acetate5H-Dibenzo(a,d)cyclohepten-10-ol, 8-fluoro-11-(2-propen-1-yl)-, 10-acetateRefChem:305496DTXSID2011449468-Fluoro-11-(prop-2-en-1-yl)-5H-dibenzo[a,d][7]annulen-10-yl acetate
Database identifiers
- CAS
887611-92-9- PubChem CID
- 11601989
- DTXSID
DTXSID201144946- Nikkaji
- J2.305.021H
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 496
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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